Basic Information |
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Product Name: | BIOTIN-TEG CEP |
CAS: | 198080-44-3 |
English Synonyms: | BIOTIN-TEG CEP |
MDL Number.: | MFCD08061998 |
H bond acceptor: | 16 |
H bond donor: | 3 |
Smile: | CC(C)N(C(C)C)P(OCCC#N)OC(COCCOCCOCCOCCCNC(=O)CCCC[C@H]1[C@H]2[C@@H](CS1)NC(=O)N2)COC(c3ccccc3)(c4ccc(cc4)OC)c5ccc(cc5)OC |
InChi: | InChI=1S/C52H76N5O11PS/c1-39(2)57(40(3)4)69(67-29-12-26-53)68-46(37-66-52(41-14-8-7-9-15-41,42-18-22-44(60-5)23-19-42)43-20-24-45(61-6)25-21-43)36-65-35-34-64-33-32-63-31-30-62-28-13-27-54-49(58)17-11-10-16-48-50-47(38-70-48)55-51(59)56-50/h7-9,14-15,18-25,39-40,46-48,50H,10-13,16-17,27-38H2,1-6H3,(H,54,58)(H2,55,56,59)/t46?,47-,48+,50-,69?/m1/s1 |
InChiKey: | InChIKey=JHOFQGWLXUQCDS-CAXMNVQJSA-N |
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